SCHEMBL750560

SCHEMBL750560

Oc1ccc(C2CCN(c3ccc4nnc(C(F)(F)F)n4n3)CC2)cc1F

nearest known ligand 0.56

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.56
TDP1 Q9NUW8 1/20 0.56
ALOX15 P16050 1/20 0.54
AR P10275 7/20 0.53
KCNH2 Q12809 6/20 0.53
BRD4 O60885 4/20 0.53
MAPT P10636 2/20 0.52
HPGD P15428 1/20 0.52
TP53 P04637 1/20 0.52
HSD17B10 Q99714 1/20 0.52
DPP4 P27487 2/20 0.50
DPP9 Q86TI2 1/20 0.50
DPP7 Q9UHL4 1/20 0.50
ALDH1A1 P00352 2/20 0.49
XBP1 P17861 1/20 0.49
CHEK1 O14757 1/20 0.39

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
Formic Acid SCHEMBL747953 0.94 AR (0.51) HTTTDP1ALOX15ARKCNH2
SCHEMBL748865 0.86 HTT (0.62) HTTTDP1ALOX15ARKCNH2
SCHEMBL2264757 0.84 HTT (0.57) HTTTDP1ALOX15ARKCNH2
Ammonia Solution, Strong SCHEMBL747955 0.82 AR (0.51) HTTTDP1ALOX15ARKCNH2
SCHEMBL2266350 0.81 HTT (0.62) HTTTDP1ALOX15ARKCNH2
SCHEMBL12368262 0.81 MAPT (0.70) HTTTDP1ALOX15ARKCNH2
SCHEMBL2264697 0.80 HTT (0.57) HTTTDP1ALOX15ARKCNH2
SCHEMBL2262571 0.80 AR (0.60) HTTTDP1ALOX15ARKCNH2
SCHEMBL2265318 0.79 MAPT (0.54) HTTTDP1ALOX15ARKCNH2
SCHEMBL747909 0.78 AR (0.76) HTTTDP1ALOX15ARKCNH2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2430024-A1 [1,2,4]TRIAZOLO [4,3-B]PYRIDAZINES AS LIGANDS OF THE ANDROGEN RECEPTOR AstraZeneca AB (SE) 2012-03-21 EP disclosed
WO-2010131022-A1 [1,2,4] TRIAZOLO [4,3-B] PYRIDAZINES AS LIGANDS OF THE ANDROGEN RECEPTOR ASTRAZENECA AB (SE) 2010-11-18 WO disclosed
US-20100292222-A1 CHEMICAL COMPOUNDS 751 ASTRAZENECA AB (SE) 2010-11-18 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100292222-A1 CHEMICAL COMPOUNDS 751 AR, NR5A1, KLK3 HTT 4358/4885TDP1 3452/4885ALOX15 2943/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.